SCHEMBL9338179

SCHEMBL9338179

Cc1ccc(C(=S)C=Cc2ccc(O)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.65
▸ MAOA P21397 3/20 0.65
▸ MAOB P27338 3/20 0.65
▸ RAB9A P51151 2/20 0.65
▸ POLB P06746 1/20 0.65
▸ MMP1 P03956 1/20 0.51
▸ MMP2 P08253 1/20 0.51
▸ MMP9 P14780 1/20 0.51
▸ F3 P13726 3/20 0.50
▸ ACHE P22303 1/20 0.46
▸ TYR P14679 2/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ HSD11B1 P28845 1/20 0.46
▸ SLC5A1 P13866 1/20 0.45
▸ SLC5A2 P31639 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ CYP1B1 Q16678 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ HPGD P15428 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10337730 0.93 MAPT (0.60) MAPTMAOAMAOBRAB9APOLB
SCHEMBL9338517 0.84 GPR183 (0.52) MAPTMAOAMAOBRAB9APOLB
SCHEMBL11823920 0.84 MAOB (0.66) MAPTMAOAMAOBRAB9APOLB
SCHEMBL9341603 0.84 NFE2L2 (0.60) MAPTMAOAMAOBRAB9APOLB
SCHEMBL9778908 0.84 MAPT (0.51) MAPTMAOAMAOBRAB9APOLB
SCHEMBL9338058 0.84 MAOB (0.66) MAPTMAOAMAOBRAB9APOLB
SCHEMBL9341640 0.84 MAPT (0.64) MAPTMAOAMAOBRAB9APOLB
SCHEMBL9338542 0.84 CYP1B1 (0.64) MAPTMAOAMAOBRAB9APOLB
Hydrochloric Acid SCHEMBL11815678 0.83 GPR183 (0.51) MAPTMAOAMAOBRAB9APOLB
Bromide SCHEMBL11817490 0.83 MAOB (0.64) MAPTMAOAMAOBRAB9APOLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0328668-B1 NONLINEAR OPTICAL MATERIAL NIPPON OILS & FATS CO LTD (JP) 1994-05-25 — — EP disclosed
US-5045239-A Chalcone derivative NIPPON OIL AND FATS CO., LTD. (JP) 1991-09-03 — — US disclosed
EP-0328668-A1 NONLINEAR OPTICAL MATERIAL NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 — — EP disclosed
EP-0328669-A1 CHALCONE DERIVATIVE COMPOUNDS NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 — — EP disclosed
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